SCHEMBL9965232

SCHEMBL9965232

CC12CCC3C(CCC4CC=CCC43C)C1CCC2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 10/20 1.00
AKR1B10 O60218 2/20 0.61
AKR1B1 P15121 2/20 0.61
OR51E2 Q9H255 1/20 0.61
GPBAR1 Q8TDU6 4/20 0.59
LMNA P02545 3/20 0.59
CYP3A4 P08684 3/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
SHBG P04278 2/20 0.59
SERPINA6 P08185 2/20 0.59
HSD17B3 P37058 2/20 0.59
MAPK1 P28482 1/20 0.59
PMP22 Q01453 1/20 0.59
G6PD P11413 1/20 0.59
CYP2D6 P10635 1/20 0.59
TSHR P16473 1/20 0.59
NFKB1 P19838 1/20 0.59
CYP2C19 P33261 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL334388 1.00 CYP19A1 (1.00) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL334387 1.00 CYP19A1 (1.00) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL13301261 1.00 CYP19A1 (1.00) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL4584277 1.00 CYP19A1 (1.00) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
Sulfuric Acid SCHEMBL9022915 0.94 CYP19A1 (0.88) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
Sulfuric Acid SCHEMBL7467213 0.94 CYP19A1 (0.88) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL20166975 0.82 CYP19A1 (0.70) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL1460891 0.82 CYP19A1 (0.70) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL16659742 0.82 CYP19A1 (0.69) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1
SCHEMBL11648596 0.80 CYP19A1 (0.67) CYP19A1AKR1B10AKR1B1OR51E2GPBAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591653-A Synthesis method of 5 alpha-androstane-2-alkene-17-ketone 上海药坦药物研究开发有限公司 2025-03-11 CN disclosed
CN-114728060-A Methods of treating lupus nephritis using interleukin-17 (IL-17) antagonists 诺华股份有限公司 2022-07-08 CN disclosed
CN-113637043-A Preparation method of 5 alpha-androst-2-ene-17 ketone 重庆康乐制药有限公司 2021-11-12 CN disclosed
US-20130164780-A1 Drug Identification Method BIOVIE INC. 2013-06-27 US disclosed
US-20130164780-A1 Drug Identification Method BIOVIE INC. 2013-06-27 US disclosed
US-8354396-B2 Identifying compounds that can treat autoimmune conditions; ulcerative colitis, inflammatory bowel disease, Crohn's disease, psoriasis, actinic keratosis, arthritis, multiple sclerosis, optic neuritis Harbor Therapeutics, Inc. (US) 2013-01-15 US disclosed
US-8354396-B2 Identifying compounds that can treat autoimmune conditions; ulcerative colitis, inflammatory bowel disease, Crohn's disease, psoriasis, actinic keratosis, arthritis, multiple sclerosis, optic neuritis Harbor Therapeutics, Inc. (US) 2013-01-15 US disclosed
EP-2486924-A2 Drugs and uses Harbor BioSciences, Inc. (US) 2012-08-15 EP disclosed
US-8217025-B2 Utilizing such as 4-fluoro-17-ethynylandrost-5-ene-3-,7-,17-triol; pulmonary conditions, hyperglycemia, type 2 diabetes, insulin resistance Harbor Therapeutics, Inc. (US) 2012-07-10 US disclosed
US-8217025-B2 Utilizing such as 4-fluoro-17-ethynylandrost-5-ene-3-,7-,17-triol; pulmonary conditions, hyperglycemia, type 2 diabetes, insulin resistance Harbor Therapeutics, Inc. (US) 2012-07-10 US disclosed
EP-2012773-B1 DRUGS AND USES HARBOR BIOSCIENCES INC (US) 2012-06-20 EP disclosed
US-20080221074-A1 Drug Screen and Treatment Method BIOVIE INC. 2008-09-11 US disclosed
US-20080221074-A1 Drug Screen and Treatment Method BIOVIE INC. 2008-09-11 US disclosed
US-20080153792-A1 Drug Identification and Treatment Method BIOVIE INC. 2008-06-26 US disclosed
US-20080153792-A1 Drug Identification and Treatment Method BIOVIE INC. 2008-06-26 US disclosed
US-20080153797-A1 Drug Identification and Treatment Method BIOVIE INC. 2008-06-26 US disclosed
US-20080153797-A1 Drug Identification and Treatment Method BIOVIE INC. 2008-06-26 US disclosed
US-20080146532-A1 Utilizing such as 4-fluoro-17-ethynylandrost-5-ene-3-,7-,17-triol; pulmonary conditions, hyperglycemia, type 2 diabetes, insulin resistance BIOVIE INC. 2008-06-19 US disclosed
US-20080146532-A1 Utilizing such as 4-fluoro-17-ethynylandrost-5-ene-3-,7-,17-triol; pulmonary conditions, hyperglycemia, type 2 diabetes, insulin resistance BIOVIE INC. 2008-06-19 US disclosed
WO-2008039566-A2 DRUGS AND USES HOLLIS-EDEN PHARMACEUTICALS, INC. (US) 2008-04-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080153792-A1 Drug Identification and Treatment Method PTGER4, PTGER1, IL17A CYP19A1 271/4885AKR1B10 362/4885AKR1B1 137/4885
US-20080146532-A1 Utilizing such as 4-fluoro-17-ethynylandrost-5-ene-3-,7-,17-triol; pulmonary conditions, hyperglycemia, type 2 diabetes, insulin resistance HSD17B1, HSD17B11, HSD3B2 CYP19A1 105/4885AKR1B10 350/4885AKR1B1 91/4885
US-20080221074-A1 Drug Screen and Treatment Method HSD3B2, HSD17B2, HSD3B1 CYP19A1 42/4885AKR1B10 205/4885AKR1B1 74/4885
US-20080153797-A1 Drug Identification and Treatment Method PTGER4, PTGER1, IL17A CYP19A1 245/4885AKR1B10 351/4885AKR1B1 134/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.